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CAS 898755-85-6

:

3-[2-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)benzoyl]benzonitrile

Description:
3-[2-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)benzoyl]benzonitrile, with the CAS number 898755-85-6, is a synthetic organic compound characterized by its complex molecular structure, which includes a spirocyclic moiety and functional groups such as a benzoyl and a benzonitrile group. The presence of the dioxane and azaspiro structures suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals due to their ability to interact with biological targets. This compound may exhibit unique physical and chemical properties, including solubility in organic solvents and potential stability under various conditions. Its molecular design indicates possible interactions with receptors or enzymes, making it a candidate for further research in drug discovery. Additionally, the presence of multiple aromatic rings may contribute to its electronic properties, influencing its reactivity and interaction with other chemical species. Overall, this compound represents a class of molecules that could be valuable in therapeutic applications, pending further investigation into its biological activity and safety profile.
Formula:C22H22N2O3
InChI:InChI=1S/C22H22N2O3/c23-15-17-4-3-6-18(14-17)21(25)20-7-2-1-5-19(20)16-24-10-8-22(9-11-24)26-12-13-27-22/h1-7,14H,8-13,16H2
InChI key:InChIKey=YDJHRNPSVQERMW-UHFFFAOYSA-N
SMILES:C(N1CCC2(CC1)OCCO2)C3=C(C(=O)C4=CC(C#N)=CC=C4)C=CC=C3
Synonyms:
  • Benzonitrile, 3-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)benzoyl]-
  • 3-[2-(1,4-Dioxa-8-azaspiro[4.5]dec-8-ylmethyl)benzoyl]benzonitrile
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